qqr.h File Reference
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Classes

class  mpqc::lcao::gaussian::QQRScreen
 Implements QQR screener for shell-sets of integrals. More...
 

Namespaces

 mpqc
 The top-level namespace for all Massively Parallel Quantum Chemistry package.
 
 mpqc::lcao
 
 mpqc::lcao::gaussian
 

Functions

template<typename E , typename Bases >
QQRScreen mpqc::lcao::gaussian::create_qqr_screener (madness::World &world, const ShrPool< E > &engs, Bases &&bases, double threshold, SchwarzScreen::norm_op_type norm_func=detail::l2_norm)